Molecule ID: mol34544

SMILES: C(CN(CCc1nnn[nH]1)CCc1nnn[nH]1)c1nnn[nH]1

InChI: InChI=1S/C9H15N13/c1(7-10-16-17-11-7)4-22(5-2-8-12-18-19-13-8)6-3-9-14-20-21-15-9/h1-6H2,(H,10,11,16,17)(H,12,13,18,19)(H,14,15,20,21)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.50 QSARToolbox 0 » -1
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Charge States and Microspecies Visualization